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Substance Name: Piperidine, 4-(2-chloro-11H-dibenz(b,e)(1,4)oxathiepin-11-yl)-1-methyl-, (Z)-2-butenedioate (1:1)
RN: 83986-04-3
InChIKey: FQUVZOKDVRINNY-WLHGVMLRSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H20-Cl-N-O-S.C4-H4-O4

Molecular Weight

  • 461.9636
 
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Names and Synonyms

Synonym

  • 8-Chloro-6-(1-methyl-4-piperidyl)-6H-dibenz(b,e)-1,4-oxathiepin hydrogen maleate

Systematic Name

  • Piperidine, 4-(2-chloro-11H-dibenz(b,e)(1,4)oxathiepin-11-yl)-1-methyl-, (Z)-2-butenedioate (1:1)

Registry Numbers

CAS Registry Number

  • 83986-04-3

System Generated Number

  • 0083986043

Molecular Formulas

Molecular Formula

  • C19-H20-Cl-N-O-S.C4-H4-O4

Molecular Formula Fragments

  • C19-H20-Cl-N-O-S
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C19H20ClNOS.C4H4O4/c1-21-10-8-13(9-11-21)19-15-12-14(20)6-7-17(15)23-18-5-3-2-4-16(18)22-19;5-3(6)1-2-4(7)8/h2-7,12-13,19H,8-11H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1+

InChIKey

FQUVZOKDVRINNY-WLHGVMLRSA-N

Smiles

CN1CCC(CC1)C2c3cc(ccc3Sc4ccccc4O2)Cl.C(=C/C(=O)O)\C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 144mg/kg (144mg/kg)   Collection of Czechoslovak Chemical Communications. Vol. 47, Pg. 3077, 1982.